N-[[5-(2-bromanyl-4-methyl-phenyl)furan-2-yl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[[5-(2-bromanyl-4-methyl-phenyl)furan-2-yl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[[5-(2-bromo-4-methyl-phenyl)-2-furyl]methyleneamino]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[[5-(2-bromo-4-methylphenyl)-2-furanyl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[[5-(2-bromo-4-methylphenyl)furan-2-yl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[[5-(2-bromo-4-methyl-phenyl)-2-furyl]methyleneamino]-5-nitro-benzothiophene-2-carboxamide Formula: C21H14BrN3O4S MolecularWeight: 484.32256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=CC=C(O2)C=NNC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-])Br

Isomeric SMILES

CC1=CC(=C(C=C1)C2=CC=C(O2)C=NNC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-])Br

InChI

InChI=1S/C21H14BrN3O4S/c1-12-2-5-16(17(22)8-12)18-6-4-15(29-18)11-23-24-21(26)20-10-13-9-14(25(27)28)3-7-19(13)30-20/h2-11H,1H3,(H,24,26)